5-tert-butyl-2-methyl-N-[1-(phenylsulfanylmethyl)pyrazol-4-yl]pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-2-methyl-N-[1-(phenylsulfanylmethyl)pyrazol-4-yl]pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-2-methyl-N-[1-(phenylsulfanylmethyl)pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 5-tert-butyl-2-methyl-N-[1-[(phenylthio)methyl]-4-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 5-tert-butyl-2-methyl-N-[1-(phenylsulfanylmethyl)pyrazol-4-yl]pyrazole-3-carboxamide Traditional Name: 5-tert-butyl-2-methyl-N-[1-[(phenylthio)methyl]pyrazol-4-yl]pyrazole-3-carboxamide Formula: C19H23N5OS MolecularWeight: 369.48382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CN(N=C2)CSC3=CC=CC=C3)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CN(N=C2)CSC3=CC=CC=C3)C

InChI

InChI=1S/C19H23N5OS/c1-19(2,3)17-10-16(23(4)22-17)18(25)21-14-11-20-24(12-14)13-26-15-8-6-5-7-9-15/h5-12H,13H2,1-4H3,(H,21,25)